CID 9570814

73747-51-0

Structural Information

Molecular Formula
C14H19NO
SMILES
CCCCC/C(=N/O)/C1CC2=CC=CC=C12
InChI
InChI=1S/C14H19NO/c1-2-3-4-9-14(15-16)13-10-11-7-5-6-8-12(11)13/h5-8,13,16H,2-4,9-10H2,1H3/b15-14-
InChIKey
COQBERCRRAMCJP-PFONDFGASA-N
Compound name
(NZ)-N-[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)hexylidene]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.14667 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.153946 151.1
[M+Na]+ 240.135888 155.8
[M-H]- 216.139394 154.9
[M+NH4]+ 235.180493 164.0
[M+K]+ 256.109828 156.0
[M+H-H2O]+ 200.143930 139.3
[M+HCOO]- 262.144871 172.3
[M+CH3COO]- 276.160521 196.3
[M+Na-2H]- 238.121336 156.0
[M]+ 217.14612142 160.7
[M]- 217.14721858 160.7
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.