CID 12627987

(2,3-dimethylcycloprop-2-en-1-yl)methanol

Structural Information

Molecular Formula
C6H10O
SMILES
CC1=C(C1CO)C
InChI
InChI=1S/C6H10O/c1-4-5(2)6(4)3-7/h6-7H,3H2,1-2H3
InChIKey
HXVBFRLIDBYJMF-UHFFFAOYSA-N
Compound name
(2,3-dimethylcycloprop-2-en-1-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

98.073166 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 99.080442 116.2
[M+Na]+ 121.062384 127.8
[M-H]- 97.065890 120.7
[M+NH4]+ 116.106989 134.9
[M+K]+ 137.036324 125.6
[M+H-H2O]+ 81.070426 111.5
[M+HCOO]- 143.071367 140.5
[M+CH3COO]- 157.087017 170.7
[M+Na-2H]- 119.047832 123.3
[M]+ 98.07261742 120.4
[M]- 98.07371458 120.4
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.