MassBank Record: MSJ00080



 (R)-(+)-Limonene; APCI-Q; MS; positive; APCI; H+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: MSJ00080
RECORD_TITLE: (R)-(+)-Limonene; APCI-Q; MS; positive; APCI; H+
DATE: 2019.01.31
AUTHORS: , Motoshi Sakakura, Application Development, AMR, Tokyo, Japan
LICENSE: CC BY
COPYRIGHT: Motoshi Sakakura, Application Development, AMR, Tokyo, Japan
PUBLICATION: Motoshi Sakakura, J. Mass Spectrom. Soc, Jpn., 66(1), 15-24 (2018).
COMMENT: One micro litter of the liquid sample was dropped in a 10 mL glass vial. The vial was placed under the DART ion source.
COMMENT: (R)-(+)-Limonene was purchased from Wako 124-03892.
COMMENT: This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 16HP2005 to the Mass Spectrometry Society of Japan.
COMMENT: Direct analysis in real time (DART) is a method of atmospheric pressure chemical ionization (APCI). Protons, H+, generated by glow discharge ionization (- 5 kV) of the He gas in the ionization chamber, DART-SVP (IonSense Inc., MA, USA), were major reactant ions for the chemical ionization of samples.
COMMENT: The interface introducing the product ions to the mass spectrometer was Vapur Interface (AMR. Inc., Tokyo, Japan). The pressure in the interface was 710 Torr (96.3 kPa).

CH$NAME: (R)-(+)-Limonene CH$COMPOUND_CLASS: Natural products; Monoterpenes CH$FORMULA: C10H16 CH$EXACT_MASS: 136.1252 CH$SMILES: CC1=CC[C@@H](CC1)C(=C)C CH$IUPAC: InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1 CH$LINK: CHEMSPIDER 389747 CH$LINK: INCHIKEY XMGQYMWWDOXHJM-JTQLQIEISA-N CH$LINK: PUBCHEM CID:440917 CH$LINK: COMPTOX DTXSID1020778
AC$INSTRUMENT: LCMS-2020 (SHIMADZU Corp., Kyoto, Japan) AC$INSTRUMENT_TYPE: APCI-Q AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: REACTANT_IONS H+
PK$SPLASH: splash10-0ukl-0497000000-83f8c283cf428005ba2c PK$NUM_PEAK: 58 PK$PEAK: m/z int. rel.int. 106.95 2967 62 135.06 26125 550 136.85 4644 98 151.02 28728 605 153.1 5761 121 154.1 9435 199 154.93 5462 115 166.99 7864 166 169.07 9341 197 186.08 5010 105 192.99 3464 73 194.06 2904 61 202.09 3434 72 269.13 7550 159 271.12 32154 677 272.06 5430 114 273.09 34573 728 274.12 7480 157 275.04 4234 89 283.24 2812 59 285.11 10632 224 287.12 27396 577 289.16 16395 345 291.16 47457 999 292.2 11077 233 293.12 4080 86 295.14 2669 56 301.14 6075 128 303.1 29413 619 305.08 5193 109 306.12 3034 64 307.13 6993 147 317.08 4417 93 319.11 16066 338 320.19 3606 76 321.1 7729 163 322.29 4214 89 335.17 3051 64 336.14 4047 85 337.16 6168 130 338.12 14638 308 339.22 4174 88 352.3 3652 77 354.24 16876 355 355.29 3622 76 356.18 3346 70 368.06 3251 68 370.24 16024 337 386.2 7432 156 387.26 3009 63 407.41 4568 96 421.32 2395 50 423.34 3435 72 425.55 2990 63 439.16 3380 71 441.33 2476 52 455.37 2679 56 506.33 3654 77 //

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