CID 12159811

158956-34-4

Structural Information

Molecular Formula

C₆H₁₀O

SMILES

C1CC1/C=C/CO

InChI

InChI=1S/C6H10O/c7-5-1-2-6-3-4-6/h1-2,6-7H,3-5H2/b2-1+

InChIKey

UKPAEMCHJQUQCQ-OWOJBTEDSA-N

Compound name

(E)-3-cyclopropylprop-2-en-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 98.073166 Da
Monoisotopic Mass: 1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	99.080442	119.7
[M+Na]+	121.06238	131.9
[M+NH4]+	116.10699	128.9
[M+K]+	137.03632	127.4
[M-H]-	97.065890	127.3
[M+Na-2H]-	119.04783	127.6
[M]+	98.072617	124.5
[M]-	98.073715	124.5

Literature stripe

literature stripe

Patent stripe

patents stripe