CID 68316842

121609-38-9

Structural Information

Molecular Formula
C7H14O
SMILES
CCC1CC(C1)CO
InChI
InChI=1S/C7H14O/c1-2-6-3-7(4-6)5-8/h6-8H,2-5H2,1H3
InChIKey
JLIIZUPFAWSETP-UHFFFAOYSA-N
Compound name
(3-ethylcyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
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 122.2
[M+Na]+ 137.09368 128.0
[M-H]- 113.09718 124.5
[M+NH4]+ 132.13828 138.1
[M+K]+ 153.06762 130.0
[M+H-H2O]+ 97.101720 113.0
[M+HCOO]- 159.10266 142.8
[M+CH3COO]- 173.11831 172.4
[M+Na-2H]- 135.07913 127.5
[M]+ 114.10391 129.6
[M]- 114.10501 129.6
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.