CID 171039390

Dtxsid60825433

Structural Information

Molecular Formula
C9H10O
SMILES
CO/C/1=C/C=C\C=C/C=C1
InChI
InChI=1S/C9H10O/c1-10-9-7-5-3-2-4-6-8-9/h2-8H,1H3/b3-2-,4-2?,5-3?,6-4-,7-5?,8-6?,9-7?,9-8+
InChIKey
YFWWZNBRXHMZOC-MVNLMLFXSA-N
Compound name
methoxycyclooctatetraene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

134.07317 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.08045 134.6
[M+Na]+ 157.06239 139.2
[M+NH4]+ 152.10699 137.9
[M+K]+ 173.03633 138.5
[M-H]- 133.06589 135.8
[M+Na-2H]- 155.04784 139.3
[M]+ 134.07262 135.6
[M]- 134.07372 135.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.