CID 21996040

(1-ethylcyclobutyl)methanol

Structural Information

Molecular Formula
C7H14O
SMILES
CCC1(CCC1)CO
InChI
InChI=1S/C7H14O/c1-2-7(6-8)4-3-5-7/h8H,2-6H2,1H3
InChIKey
MFAVFTVSWZTMIC-UHFFFAOYSA-N
Compound name
(1-ethylcyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

97
Patents

114.10446 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.11174 123.6
[M+Na]+ 137.09368 129.8
[M+NH4]+ 132.13828 130.0
[M+K]+ 153.06762 124.3
[M-H]- 113.09718 122.1
[M+Na-2H]- 135.07913 127.8
[M]+ 114.10391 123.0
[M]- 114.10501 123.0
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

patents stripe