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2-Methylheptane
SpectraBase Compound ID 7076Q0v5ftG
InChI InChI=1S/C8H18/c1-4-5-6-7-8(2)3/h8H,4-7H2,1-3H3
InChIKey JVSWJIKNEAIKJW-UHFFFAOYSA-N
Mol Weight 114.23 g/mol
Molecular Formula C8H18
Exact Mass 114.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21Zw33TGmu
Name Heptane, 2-methyl-
Alternate Name(s) (CH3)2CH(CH2)4CH3 2-Methylheptane Methylheptane EINECS 209-747-9 EINECS 247-861-0 NSC 24844
CAS Registry Number 592-27-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18
InChI InChI=1S/C8H18/c1-4-5-6-7-8(2)3/h8H,4-7H2,1-3H3
InChIKey JVSWJIKNEAIKJW-UHFFFAOYSA-N
Molecular Weight 114.232 g/mol
SMILES CC(CCCCC)C
SPLASH splash10-052f-9000000000-531f99fa1a8cb6436e92
Source of Spectrum HE-1982-0-0
Wiley ID 1124917