CID 137701

1-methylcyclopropanemethanol

Structural Information

Molecular Formula

C₅H₁₀O

SMILES

CC1(CC1)CO

InChI

InChI=1S/C5H10O/c1-5(4-6)2-3-5/h6H,2-4H2,1H3

InChIKey

PIZQWRXTMGASCZ-UHFFFAOYSA-N

Compound name

(1-methylcyclopropyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1233
Patents: 86.073166 Da
Monoisotopic Mass: 0.7
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]+	87.080442	117.8
[M+Na]+	109.06238	130.3
[M+NH4]+	104.10699	128.8
[M+K]+	125.03632	124.6
[M-H]-	85.065890	125.9
[M+Na-2H]-	107.04783	127.5
[M]+	86.072617	123.1
[M]-	86.073715	123.1

Literature stripe

literature stripe

Patent stripe

patents stripe